2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodanyl-4,5-dimethoxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodanyl-4,5-dimethoxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodo-4,5-dimethoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodo-4,5-dimethoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodo-4,5-dimethoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodo-4,5-dimethoxy-benzylidene)amino]acetamide Formula: C18H18IN3O5 MolecularWeight: 483.25709

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CNC2=CC3=C(C=C2)OCO3)I)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)CNC2=CC3=C(C=C2)OCO3)I)OC

InChI

InChI=1S/C18H18IN3O5/c1-24-16-6-11(5-13(19)18(16)25-2)8-21-22-17(23)9-20-12-3-4-14-15(7-12)27-10-26-14/h3-8,20H,9-10H2,1-2H3,(H,22,23)/b21-8+